4-[5-(4-methyl-7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(4-methyl-7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(4-methyl-7-propyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(4-methyl-7-propyl-2-benzofuranyl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(4-methyl-7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(4-methyl-7-propyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C23H21NO3 MolecularWeight: 359.41774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=C(C=C1)C)C=C(O2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCCC1=C2C(=C(C=C1)C)C=C(O2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H21NO3/c1-3-4-16-6-5-14(2)18-13-21(27-22(16)18)20-12-11-19(24-20)15-7-9-17(10-8-15)23(25)26/h5-13,24H,3-4H2,1-2H3,(H,25,26)